#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x1x h TYR 114 N 0.00 0.00 -0.18 1.57 -0.00 -2.07 -2.38 116.97 113.92 2x1x h TYR 114 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.70 2x1x h TYR 114 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.72 2x1x h TYR 114 CO 0.00 0.00 -0.02 -0.91 -0.00 0.00 0.00 178.16 177.23 2x1x h ASN 115 N 0.00 0.23 -0.29 0.10 -0.26 -2.05 -1.95 115.58 111.36 2x1x h ASN 115 Ca 0.00 -0.03 -0.07 0.00 -0.56 0.00 0.00 56.30 55.64 2x1x h ASN 115 Cb 0.16 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.34 2x1x h ASN 115 CO 0.00 0.30 -0.04 0.74 -1.06 0.00 0.00 177.43 177.37 2x1x h THR 116 N 0.25 1.23 -0.68 2.81 2.02 -1.85 -0.59 112.91 116.10 2x1x h THR 116 Ca 0.06 -0.97 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 2x1x h THR 116 Cb 0.21 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 2x1x h THR 116 CO 0.01 0.33 0.36 -0.33 0.37 0.00 0.00 175.52 176.26 2x1x h GLU 117 N 0.62 0.95 -0.19 6.66 3.07 -1.48 0.13 114.58 124.34 2x1x h GLU 117 Ca 0.12 -0.12 -0.12 0.00 -0.50 0.00 0.00 59.36 58.74 2x1x h GLU 117 Cb 0.45 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 2x1x h GLU 117 CO 0.02 0.73 -0.36 0.82 -1.40 0.00 0.00 179.01 178.82 2x1x h ILE 118 N 0.93 1.34 -0.29 3.13 5.03 -1.33 -3.03 117.51 123.28 2x1x h ILE 118 Ca 0.24 -1.59 -0.00 0.00 -0.12 0.00 0.00 64.86 63.38 2x1x h ILE 118 Cb 0.06 1.89 -0.01 0.00 -3.03 0.00 0.00 36.82 35.72 2x1x h ILE 118 CO -0.04 0.49 0.17 -0.07 -0.68 0.00 0.00 178.15 178.02 2x1x h LEU 119 N 0.24 0.36 -0.39 1.44 -0.00 -0.97 -1.95 115.31 114.03 2x1x h LEU 119 Ca 0.01 -0.07 0.08 0.00 -0.00 0.00 0.00 57.88 57.90 2x1x h LEU 119 Cb 0.95 -0.09 -0.07 0.00 -0.00 0.00 0.00 40.66 41.45 2x1x h LEU 119 CO 0.08 0.32 -0.09 0.50 -0.00 0.00 0.00 178.44 179.25 2x1x h LYS 120 N 0.37 0.00 -0.34 1.13 3.11 -0.79 -1.83 116.57 118.21 2x1x h LYS 120 Ca 0.10 -0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 57.84 2x1x h LYS 120 Cb 0.03 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.25 2x1x h LYS 120 CO -0.02 0.00 -0.23 0.66 -2.81 0.00 0.00 179.45 177.05 2x1x h SER 121 N 0.00 0.67 0.47 4.20 4.64 -1.39 -2.54 113.55 119.61 2x1x h SER 121 Ca 0.19 -0.24 -0.20 0.00 -0.47 0.00 0.00 61.79 61.07 2x1x h SER 121 Cb 0.28 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2x1x h SER 121 CO -0.40 0.89 -0.88 -0.29 -0.87 0.00 0.00 176.83 175.29 2x1x h ILE 122 N 0.58 1.45 -0.32 0.95 2.10 -1.00 -0.94 117.51 120.35 2x1x h ILE 122 Ca 0.08 -2.51 -0.13 0.00 1.08 0.00 0.00 64.86 63.39 2x1x h ILE 122 Cb 0.71 2.41 -0.01 0.00 -1.09 0.00 0.00 36.82 38.84 2x1x h ILE 122 CO 0.05 0.74 -0.30 -0.78 -1.08 0.00 0.00 178.15 176.78 2x1x h ASP 123 N 0.16 0.82 -0.55 2.19 1.82 -1.34 -2.39 116.42 117.13 2x1x h ASP 123 Ca -0.05 -0.46 0.02 0.00 -0.39 0.00 0.00 57.03 56.14 2x1x h ASP 123 Cb 1.50 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 41.25 2x1x h ASP 123 CO 0.14 1.11 0.36 -1.13 -1.61 0.00 0.00 179.24 178.12 2x1x h ASN 124 N 0.54 0.58 -0.20 2.28 -1.24 -1.38 -2.05 115.58 114.11 2x1x h ASN 124 Ca 0.05 -0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.00 2x1x h ASN 124 Cb 0.88 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 39.78 2x1x h ASN 124 CO 0.08 0.41 -0.09 -0.08 -1.29 0.00 0.00 177.43 176.45 2x1x h GLU 125 N 0.68 0.42 -1.00 6.67 4.57 -0.90 -1.89 114.58 123.12 2x1x h GLU 125 Ca 0.21 -0.18 0.05 0.00 -1.18 0.00 0.00 59.36 58.26 2x1x h GLU 125 Cb 0.02 -0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.53 2x1x h GLU 125 CO -0.05 0.70 0.65 -1.49 -1.18 0.00 0.00 179.01 177.64 2x1x h TRP 126 N 0.12 1.21 -0.27 0.92 6.55 -1.22 -2.27 115.95 120.98 2x1x h TRP 126 Ca 0.05 0.03 -0.04 0.00 0.95 0.00 0.00 58.89 59.87 2x1x h TRP 126 Cb 0.57 -0.40 -0.01 0.00 -0.86 0.00 0.00 29.16 28.46 2x1x h TRP 126 CO 0.06 0.67 0.01 -0.09 -1.05 0.00 0.00 178.44 178.04 2x1x h ARG 127 N 1.23 0.48 0.00 0.49 2.43 -1.19 -2.62 114.38 115.19 2x1x h ARG 127 Ca 0.41 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2x1x h ARG 127 Cb 0.07 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2x1x h ARG 127 CO -0.14 0.63 0.00 0.87 -1.51 0.00 0.00 179.97 179.81 2x1x h LYS 128 N 0.27 0.00 -0.27 0.20 1.57 -1.21 -3.23 116.57 113.90 2x1x h LYS 128 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2x1x h LYS 128 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2x1x h LYS 128 CO 0.01 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.14 2x1x n THR 129 N -3.04 0.49 -0.93 -0.16 -2.24 -0.87 -5.03 114.28 102.50 2x1x n THR 129 Ca 0.02 -0.75 -0.29 0.00 -2.27 0.00 0.00 64.05 60.76 2x1x n THR 129 Cb 0.39 0.93 0.18 0.00 -2.10 0.00 0.00 70.33 69.73 2x1x n THR 129 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x1x s GLN 130 N -1.19 0.38 -0.51 -0.78 -2.07 -1.00 -0.75 119.66 113.74 2x1x s GLN 130 Ca 0.27 0.86 -0.28 0.00 -1.82 0.00 0.00 55.36 54.39 2x1x s GLN 130 Cb 0.16 -1.70 -0.01 0.00 -1.09 0.00 0.00 33.01 30.37 2x1x s GLN 130 CO 0.22 -2.85 1.65 0.00 -1.32 0.00 0.00 175.29 172.99 2x1x s MET 132 N 5.98 1.02 0.22 0.00 0.00 -0.59 -4.63 119.30 121.29 2x1x s MET 132 Ca 0.64 -0.85 -0.30 0.00 0.00 0.00 0.00 55.69 55.18 2x1x s MET 132 Cb -0.14 0.42 -0.10 0.00 0.00 0.00 0.00 34.83 35.01 2x1x s MET 132 CO 0.26 -0.38 1.47 -2.14 0.00 0.00 0.00 175.02 174.24 2x1x s PRO 133 N -3.84 4.26 -0.04 3.16 0.02 -1.26 -1.77 135.00 135.52 2x1x s PRO 133 Ca 0.05 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.40 2x1x s PRO 133 Cb 0.03 -3.13 0.01 0.00 0.02 0.00 0.00 34.50 31.43 2x1x s PRO 133 CO -0.10 -0.47 -0.09 1.03 -0.33 0.00 0.00 177.00 177.04 2x1x s ARG 134 N 0.14 1.08 -0.10 5.54 0.52 0.20 -4.89 118.95 121.45 2x1x s ARG 134 Ca 0.63 -0.28 -0.29 0.00 -0.52 0.00 0.00 55.73 55.26 2x1x s ARG 134 Cb -0.42 -0.99 -0.05 0.00 0.52 0.00 0.00 34.95 34.01 2x1x s ARG 134 CO 0.39 0.05 1.66 -2.00 0.02 0.00 0.00 175.30 175.42 2x1x s GLU 135 N 0.44 4.06 0.10 3.54 2.12 -1.26 -0.74 118.70 126.97 2x1x s GLU 135 Ca -0.07 2.06 0.04 0.00 0.36 0.00 0.00 54.97 57.35 2x1x s GLU 135 Cb -0.11 -4.01 -0.04 0.00 0.26 0.00 0.00 34.13 30.23 2x1x s GLU 135 CO 0.01 -0.99 -0.10 0.14 -0.54 0.00 0.00 175.26 173.78 2x1x s VAL 136 N 4.43 1.00 0.02 3.70 -7.23 -0.08 -4.96 120.40 117.28 2x1x s VAL 136 Ca 0.74 -1.70 -0.23 0.00 -1.81 0.00 0.00 61.98 58.97 2x1x s VAL 136 Cb -0.31 -1.44 -0.05 0.00 0.56 0.00 0.00 36.38 35.13 2x1x s VAL 136 CO 0.29 -0.58 0.71 0.00 -0.31 0.00 0.00 175.10 175.22 2x1x s ALA 137 N -2.55 3.40 -0.20 1.32 0.00 -1.26 -2.02 121.76 120.45 2x1x s ALA 137 Ca 0.07 0.19 -0.02 0.00 0.00 0.00 0.00 51.96 52.20 2x1x s ALA 137 Cb -0.02 -2.92 -0.00 0.00 0.00 0.00 0.00 23.12 20.18 2x1x s ALA 137 CO 0.00 0.08 -0.09 0.42 0.00 0.00 0.00 175.76 176.18 2x1x s ILE 138 N -0.04 3.01 -0.10 0.00 -1.09 -0.67 -4.96 121.20 117.35 2x1x s ILE 138 Ca 0.36 -0.62 -0.29 0.00 -2.23 0.00 0.00 60.65 57.87 2x1x s ILE 138 Cb -0.20 -2.34 -0.05 0.00 -1.58 0.00 0.00 42.46 38.29 2x1x s ILE 138 CO 0.21 0.46 1.77 -0.62 -1.23 0.00 0.00 174.94 175.53 2x1x s ASP 139 N 1.35 6.41 0.02 3.58 3.68 -1.26 -2.49 116.67 127.96 2x1x s ASP 139 Ca 0.04 2.12 -0.29 0.00 2.13 0.00 0.00 52.55 56.55 2x1x s ASP 139 Cb -0.14 -2.53 -0.16 0.00 -1.45 0.00 0.00 42.92 38.64 2x1x s ASP 139 CO -0.05 -1.16 1.20 0.58 0.13 0.00 0.00 175.17 175.87 2x1x h VAL 140 N 5.91 0.02 0.00 1.11 2.07 -1.75 -2.96 116.25 120.66 2x1x h VAL 140 Ca -0.40 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2x1x h VAL 140 Cb 1.19 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2x1x h VAL 140 CO 0.96 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.17 2x1x n GLY 141 N -0.85 -0.02 0.09 2.17 0.00 -1.26 -1.62 105.19 103.69 2x1x n GLY 141 Ca -0.13 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 2x1x n GLY 141 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x1x n LYS 142 N -0.90 0.69 0.10 1.61 4.76 -1.14 -1.51 118.16 121.77 2x1x n LYS 142 Ca 0.00 0.09 -0.12 0.00 -2.87 0.00 0.00 58.31 55.41 2x1x n LYS 142 Cb 0.00 -1.38 -0.08 0.00 -1.84 0.00 0.00 35.03 31.73 2x1x n LYS 142 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2x1x h GLU 143 N 0.00 -0.28 0.00 1.97 4.39 -1.15 -2.62 114.58 116.89 2x1x h GLU 143 Ca -0.42 0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.27 2x1x h GLU 143 Cb 1.72 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 30.43 2x1x h GLU 143 CO -0.05 0.10 -0.12 0.35 -1.16 0.00 0.00 179.01 178.12 2x1x h PHE 144 N -0.76 0.00 -6.20 4.33 3.57 -1.62 -3.47 116.94 112.79 2x1x h PHE 144 Ca -0.03 0.00 -0.44 0.00 3.53 0.00 0.00 57.97 61.03 2x1x h PHE 144 Cb 0.50 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.27 2x1x h PHE 144 CO 0.05 0.12 -0.85 0.41 -2.23 0.00 0.00 178.31 175.81 2x1x n GLY 145 N -0.80 -0.32 0.00 2.40 0.00 -0.99 -4.95 105.19 100.52 2x1x n GLY 145 Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2x1x n GLY 145 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2x1x n VAL 146 N -4.29 0.00 -3.78 1.61 0.24 -0.57 -4.95 118.33 106.60 2x1x n VAL 146 Ca -0.29 0.44 -0.07 0.00 -2.04 0.00 0.00 64.34 62.38 2x1x n VAL 146 Cb 0.68 -1.32 -0.02 0.00 -1.47 0.00 0.00 33.84 31.71 2x1x n VAL 146 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x1x s ALA 147 N -2.24 -1.35 0.29 2.33 0.00 -1.26 -5.02 121.76 114.50 2x1x s ALA 147 Ca 0.00 -0.11 0.15 0.00 0.00 0.00 0.00 51.96 52.00 2x1x s ALA 147 Cb 0.00 0.81 0.64 0.00 0.00 0.00 0.00 23.12 24.57 2x1x s ALA 147 CO 0.00 -1.00 1.75 1.79 0.00 0.00 0.00 175.76 178.30 2x1x h THR 148 N 2.00 1.17 -0.23 0.00 1.35 -2.00 -3.24 112.91 111.95 2x1x h THR 148 Ca -0.22 -1.56 -0.10 0.00 -0.55 0.00 0.00 66.41 63.98 2x1x h THR 148 Cb 1.25 1.87 -0.06 0.00 -1.73 0.00 0.00 68.15 69.49 2x1x h THR 148 CO 0.25 0.42 -0.14 -0.46 -0.25 0.00 0.00 175.52 175.35 2x1x n ASN 149 N -3.82 2.51 -3.90 5.36 6.94 -1.26 -4.99 115.26 116.10 2x1x n ASN 149 Ca -0.01 -3.63 -0.25 0.00 -0.02 0.00 0.00 54.58 50.67 2x1x n ASN 149 Cb 0.49 -0.58 -0.17 0.00 -2.36 0.00 0.00 39.78 37.16 2x1x n ASN 149 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2x1x s THR 150 N -3.15 0.86 0.05 5.53 2.01 -1.23 -1.40 115.64 118.31 2x1x s THR 150 Ca 0.42 -0.23 0.07 0.00 0.31 0.00 0.00 61.69 62.26 2x1x s THR 150 Cb 0.38 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.97 2x1x s THR 150 CO 0.00 0.33 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.74 2x1x s PHE 151 N 1.47 2.63 -0.06 4.92 0.08 0.26 -4.67 117.98 122.61 2x1x s PHE 151 Ca -0.01 -0.21 0.04 0.00 0.12 0.00 0.00 56.93 56.87 2x1x s PHE 151 Cb -0.13 -1.48 -0.02 0.00 -0.57 0.00 0.00 43.02 40.82 2x1x s PHE 151 CO -0.04 0.30 -0.16 -0.06 -0.10 0.00 0.00 175.22 175.15 2x1x s PHE 152 N -0.98 2.66 -0.21 0.36 0.08 -1.26 0.37 117.98 119.00 2x1x s PHE 152 Ca 0.16 -0.33 -0.01 0.00 0.12 0.00 0.00 56.93 56.87 2x1x s PHE 152 Cb -0.11 -1.66 0.06 0.00 -0.57 0.00 0.00 43.02 40.74 2x1x s PHE 152 CO 0.07 0.05 -0.03 0.15 -0.10 0.00 0.00 175.22 175.36 2x1x s LYS 153 N -0.46 1.31 0.66 0.44 3.01 -0.21 -2.65 119.74 121.83 2x1x s LYS 153 Ca 0.05 -0.72 -0.13 0.00 -1.01 0.00 0.00 55.97 54.16 2x1x s LYS 153 Cb -0.12 -2.33 -0.01 0.00 -1.01 0.00 0.00 37.83 34.37 2x1x s LYS 153 CO 0.02 -0.57 1.07 -2.14 0.51 0.00 0.00 175.35 174.23 2x1x s PRO 154 N 1.58 3.02 0.52 -1.68 0.02 -1.26 -1.21 135.00 135.99 2x1x s PRO 154 Ca -0.03 1.12 0.25 0.00 0.02 0.00 0.00 61.00 62.35 2x1x s PRO 154 Cb -0.18 -2.00 1.42 0.00 0.02 0.00 0.00 34.50 33.77 2x1x s PRO 154 CO -0.07 -1.05 2.09 -1.35 -0.33 0.00 0.00 177.00 176.30 2x1x h PRO 155 N -0.21 0.00 -4.98 5.54 0.11 -1.92 -3.46 132.00 127.08 2x1x h PRO 155 Ca -0.45 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 65.26 2x1x h PRO 155 Cb 1.22 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.19 2x1x h PRO 155 CO 0.56 0.11 -0.60 0.00 -0.21 0.00 0.00 178.00 177.86 2x1x s VAL 157 N -3.59 0.62 -0.36 0.00 -7.23 -1.04 -4.94 120.40 103.85 2x1x s VAL 157 Ca 0.36 -0.73 -0.22 0.00 -1.81 0.00 0.00 61.98 59.59 2x1x s VAL 157 Cb 0.07 -0.60 0.01 0.00 0.56 0.00 0.00 36.38 36.42 2x1x s VAL 157 CO 0.15 -0.10 0.70 -0.55 -0.31 0.00 0.00 175.10 174.98 2x1x s SER 158 N -0.91 6.47 0.05 4.85 0.15 -1.26 -1.68 113.70 121.37 2x1x s SER 158 Ca -0.03 0.20 -0.04 0.00 0.70 0.00 0.00 55.95 56.78 2x1x s SER 158 Cb -0.06 -2.35 -0.02 0.00 -1.71 0.00 0.00 66.02 61.87 2x1x s SER 158 CO 0.00 -0.66 0.06 0.68 1.20 0.00 0.00 173.24 174.52 2x1x s VAL 159 N 2.88 0.17 -0.26 4.45 -7.23 -0.85 -4.98 120.40 114.58 2x1x s VAL 159 Ca 0.27 -1.40 -0.14 0.00 -1.81 0.00 0.00 61.98 58.89 2x1x s VAL 159 Cb -0.14 -1.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.54 2x1x s VAL 159 CO 0.16 -0.78 0.35 -0.31 -0.31 0.00 0.00 175.10 174.22 2x1x s TYR 160 N -3.38 3.27 0.15 2.82 1.51 -1.26 -0.90 117.35 119.56 2x1x s TYR 160 Ca 0.02 0.41 0.09 0.00 -1.01 0.00 0.00 57.07 56.58 2x1x s TYR 160 Cb 0.04 -2.53 -0.04 0.00 -0.11 0.00 0.00 41.96 39.32 2x1x s TYR 160 CO -0.08 -0.17 -0.21 1.03 -1.11 0.00 0.00 175.55 175.01 2x1x s ARG 161 N 1.85 1.29 -0.07 -0.62 1.81 0.08 -1.01 118.95 122.28 2x1x s ARG 161 Ca 0.15 -1.36 -0.30 0.00 -1.72 0.00 0.00 55.73 52.50 2x1x s ARG 161 Cb -0.15 -1.49 -0.03 0.00 -0.45 0.00 0.00 34.95 32.82 2x1x s ARG 161 CO 0.09 0.32 1.23 0.00 -0.68 0.00 0.00 175.30 176.26 2x1x n GLY 163 N 3.43 3.88 0.00 0.00 0.00 -0.73 -4.91 105.19 106.86 2x1x n GLY 163 Ca 0.12 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2x1x n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x1x n GLY 164 N 0.71 -1.92 3.22 -0.02 0.00 -1.26 -1.55 105.19 104.38 2x1x n GLY 164 Ca 0.00 -2.15 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 2x1x n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x1x h ASN 167 N 3.91 0.00 -3.70 0.00 2.35 -2.01 -3.41 115.58 112.73 2x1x h ASN 167 Ca -0.50 0.00 -0.66 0.00 -0.55 0.00 0.00 56.30 54.59 2x1x h ASN 167 Cb 1.19 0.00 -0.37 0.00 0.05 0.00 0.00 38.32 39.20 2x1x h ASN 167 CO 0.67 0.13 -0.81 -0.55 -1.65 0.00 0.00 177.43 175.22 2x1x s SER 168 N -6.18 4.14 0.10 5.81 0.15 -1.26 -5.10 113.70 111.36 2x1x s SER 168 Ca 0.05 -1.24 -0.36 0.00 0.70 0.00 0.00 55.95 55.10 2x1x s SER 168 Cb 0.07 -1.49 -0.16 0.00 -1.71 0.00 0.00 66.02 62.73 2x1x s SER 168 CO 0.66 -0.16 1.43 -0.62 1.20 0.00 0.00 173.24 175.76 2x1x n GLU 169 N 4.49 1.49 0.00 5.44 1.02 -1.26 -0.64 120.64 131.19 2x1x n GLU 169 Ca -0.15 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.53 2x1x n GLU 169 Cb 0.44 -2.23 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 2x1x n GLU 169 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x1x n GLY 170 N 2.87 0.66 3.14 0.62 0.00 -1.26 -5.05 105.19 106.17 2x1x n GLY 170 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2x1x n GLY 170 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x1x s LEU 171 N 0.00 1.99 0.19 0.99 1.43 0.19 -1.35 118.68 122.12 2x1x s LEU 171 Ca 0.00 -0.54 0.11 0.00 -1.03 0.00 0.00 54.13 52.67 2x1x s LEU 171 Cb 0.00 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 2x1x s LEU 171 CO 0.00 0.08 -0.22 0.00 0.23 0.00 0.00 176.35 176.44 2x1x s GLN 172 N 0.76 1.46 -0.32 1.70 -2.07 -0.69 -4.64 119.66 115.85 2x1x s GLN 172 Ca -0.10 -1.51 -0.29 0.00 -1.82 0.00 0.00 55.36 51.64 2x1x s GLN 172 Cb -0.16 -1.67 -0.01 0.00 -1.09 0.00 0.00 33.01 30.09 2x1x s GLN 172 CO 0.01 0.35 1.52 0.00 -1.32 0.00 0.00 175.29 175.84 2x1x s MET 174 N 4.84 0.69 0.43 0.00 -1.94 -0.91 -4.89 119.30 117.52 2x1x s MET 174 Ca 0.66 -0.64 -0.23 0.00 -1.71 0.00 0.00 55.69 53.77 2x1x s MET 174 Cb -0.19 -0.61 -0.08 0.00 2.01 0.00 0.00 34.83 35.96 2x1x s MET 174 CO 0.30 0.15 1.07 0.54 -0.01 0.00 0.00 175.02 177.07 2x1x s ASN 175 N -1.09 6.54 -0.01 3.03 4.22 -1.26 -0.78 114.94 125.58 2x1x s ASN 175 Ca -0.02 2.08 0.09 0.00 -2.14 0.00 0.00 52.86 52.87 2x1x s ASN 175 Cb -0.07 -2.58 -0.13 0.00 1.28 0.00 0.00 41.25 39.74 2x1x s ASN 175 CO 0.01 -0.65 0.25 0.35 -2.04 0.00 0.00 177.10 175.02 2x1x n THR 176 N -0.35 0.00 -3.77 0.54 -2.24 0.12 -4.88 114.28 103.70 2x1x n THR 176 Ca 0.06 -0.23 -0.13 0.00 -2.27 0.00 0.00 64.05 61.48 2x1x n THR 176 Cb 0.50 0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 69.09 2x1x n THR 176 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x1x s SER 177 N -2.77 -0.28 -0.06 3.42 1.04 -1.24 -5.00 113.70 108.81 2x1x s SER 177 Ca -0.02 0.48 0.01 0.00 0.48 0.00 0.00 55.95 56.91 2x1x s SER 177 Cb 0.06 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.75 2x1x s SER 177 CO 0.39 -0.18 -0.08 -0.89 0.98 0.00 0.00 173.24 173.46 2x1x s THR 178 N -0.19 0.80 0.44 2.02 2.01 -1.26 -1.50 115.64 117.95 2x1x s THR 178 Ca -0.03 -0.27 -0.02 0.00 0.31 0.00 0.00 61.69 61.68 2x1x s THR 178 Cb -0.03 -0.78 -0.02 0.00 0.01 0.00 0.00 72.50 71.68 2x1x s THR 178 CO 0.01 0.29 0.68 -0.44 -0.69 0.00 0.00 174.62 174.47 2x1x s SER 179 N 0.87 6.09 0.12 3.53 0.01 0.18 -4.91 113.70 119.59 2x1x s SER 179 Ca -0.11 0.56 0.10 0.00 1.31 0.00 0.00 55.95 57.81 2x1x s SER 179 Cb -0.15 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 64.12 2x1x s SER 179 CO 0.01 -0.56 -0.24 -0.31 0.41 0.00 0.00 173.24 172.55 2x1x s TYR 180 N -2.56 2.38 -0.04 2.43 1.51 -1.26 0.11 117.35 119.92 2x1x s TYR 180 Ca 0.46 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.19 2x1x s TYR 180 Cb -0.10 -1.29 0.02 0.00 -0.11 0.00 0.00 41.96 40.48 2x1x s TYR 180 CO 0.40 0.34 -0.06 -0.51 -1.11 0.00 0.00 175.55 174.61 2x1x s LEU 181 N -2.02 1.50 -0.39 -1.29 1.43 0.14 -4.89 118.68 113.16 2x1x s LEU 181 Ca 0.15 -0.14 -0.18 0.00 -1.03 0.00 0.00 54.13 52.93 2x1x s LEU 181 Cb -0.10 -0.47 0.01 0.00 0.03 0.00 0.00 46.19 45.66 2x1x s LEU 181 CO 0.07 -0.01 0.49 -0.94 0.23 0.00 0.00 176.35 176.19 2x1x s SER 182 N 0.65 6.26 0.11 2.29 1.04 -1.26 0.12 113.70 122.91 2x1x s SER 182 Ca -0.09 -0.32 0.05 0.00 0.48 0.00 0.00 55.95 56.07 2x1x s SER 182 Cb -0.12 -2.25 -0.04 0.00 0.10 0.00 0.00 66.02 63.70 2x1x s SER 182 CO 0.00 -0.55 0.03 -0.54 0.98 0.00 0.00 173.24 173.17 2x1x s LYS 183 N 2.34 2.65 -0.20 4.02 1.02 -0.34 -4.93 119.74 124.30 2x1x s LYS 183 Ca 0.16 -0.84 -0.05 0.00 0.02 0.00 0.00 55.97 55.26 2x1x s LYS 183 Cb -0.16 -2.57 -0.03 0.00 -0.52 0.00 0.00 37.83 34.55 2x1x s LYS 183 CO 0.14 0.53 0.01 0.99 -0.92 0.00 0.00 175.35 176.10 2x1x s THR 184 N -1.43 4.08 0.05 2.17 2.01 -1.26 -1.13 115.64 120.13 2x1x s THR 184 Ca 0.27 -0.27 0.05 0.00 0.31 0.00 0.00 61.69 62.06 2x1x s THR 184 Cb -0.11 -2.85 -0.02 0.00 0.01 0.00 0.00 72.50 69.53 2x1x s THR 184 CO 0.20 0.43 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.64 2x1x s LEU 185 N 0.95 2.20 -0.20 4.42 1.02 0.46 -4.94 118.68 122.57 2x1x s LEU 185 Ca 0.02 -0.51 -0.29 0.00 0.02 0.00 0.00 54.13 53.37 2x1x s LEU 185 Cb -0.14 -0.64 0.00 0.00 0.02 0.00 0.00 46.19 45.43 2x1x s LEU 185 CO 0.02 0.03 1.02 -0.36 0.02 0.00 0.00 176.35 177.08 2x1x s PHE 186 N -0.94 3.37 -0.20 0.29 0.08 -0.35 -0.77 117.98 119.46 2x1x s PHE 186 Ca 0.02 1.48 -0.13 0.00 0.12 0.00 0.00 56.93 58.41 2x1x s PHE 186 Cb -0.08 -3.24 -0.05 0.00 -0.57 0.00 0.00 43.02 39.08 2x1x s PHE 186 CO 0.02 -0.42 0.28 -2.00 -0.10 0.00 0.00 175.22 172.99 2x1x s GLU 187 N 2.93 4.18 -0.12 0.44 2.12 -0.46 -1.05 118.70 126.74 2x1x s GLU 187 Ca 0.44 0.01 -0.02 0.00 0.36 0.00 0.00 54.97 55.76 2x1x s GLU 187 Cb -0.16 -3.49 -0.03 0.00 0.26 0.00 0.00 34.13 30.71 2x1x s GLU 187 CO 0.09 0.10 -0.05 0.42 -0.54 0.00 0.00 175.26 175.28 2x1x s ILE 188 N 0.90 3.85 0.11 -3.70 1.01 0.16 -2.37 121.20 121.16 2x1x s ILE 188 Ca 0.14 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.49 2x1x s ILE 188 Cb -0.13 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 2x1x s ILE 188 CO 0.05 0.55 -0.23 0.42 0.00 0.00 0.00 174.94 175.72 2x1x s THR 189 N -0.20 1.90 0.11 2.92 -4.23 -1.26 0.92 115.64 115.79 2x1x s THR 189 Ca 0.03 -1.60 0.09 0.00 -1.18 0.00 0.00 61.69 59.03 2x1x s THR 189 Cb -0.13 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 71.97 2x1x s THR 189 CO 0.02 -0.00 -0.24 0.68 -0.54 0.00 0.00 174.62 174.54 2x1x s VAL 190 N -1.12 1.98 0.24 2.29 -7.23 -0.49 -3.19 120.40 112.88 2x1x s VAL 190 Ca 0.09 -1.61 -0.31 0.00 -1.81 0.00 0.00 61.98 58.34 2x1x s VAL 190 Cb -0.10 -1.76 -0.11 0.00 0.56 0.00 0.00 36.38 34.96 2x1x s VAL 190 CO 0.05 0.05 1.63 -2.16 -0.31 0.00 0.00 175.10 174.36 2x1x s PRO 191 N -1.89 4.14 -0.33 4.82 0.04 -1.26 -4.80 135.00 135.71 2x1x s PRO 191 Ca 0.10 2.55 -0.28 0.00 0.04 0.00 0.00 61.00 63.41 2x1x s PRO 191 Cb -0.10 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 2x1x s PRO 191 CO 0.05 -0.67 2.04 -0.48 0.04 0.00 0.00 177.00 177.99 2x1x s LEU 192 N 0.38 3.45 -0.11 -3.56 2.34 -1.19 -4.70 118.68 115.28 2x1x s LEU 192 Ca 0.68 1.42 0.08 0.00 0.06 0.00 0.00 54.13 56.37 2x1x s LEU 192 Cb -0.48 -3.30 -0.12 0.00 -0.56 0.00 0.00 46.19 41.73 2x1x s LEU 192 CO 0.39 -2.01 0.01 -1.20 -1.06 0.00 0.00 176.35 172.47 2x1x n SER 193 N 11.76 2.53 -1.07 1.48 7.64 -1.26 -4.95 113.62 129.75 2x1x n SER 193 Ca 0.27 -0.01 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2x1x n SER 193 Cb 0.48 0.57 0.00 0.00 -1.01 0.00 0.00 64.21 64.24 2x1x n SER 193 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2x1x n GLN 194 N -2.49 2.31 0.00 1.43 3.00 -1.26 -5.13 117.38 115.25 2x1x n GLN 194 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 2x1x n GLN 194 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 30.24 31.06 2x1x n GLN 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2x1x n GLY 195 N 5.00 0.90 3.66 1.08 0.00 -1.26 -5.03 105.19 109.54 2x1x n GLY 195 Ca 0.00 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 2x1x n GLY 195 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2x1x s PRO 196 N -0.11 4.20 -0.19 1.61 0.02 -1.26 -4.79 135.00 134.48 2x1x s PRO 196 Ca 0.00 2.01 -0.07 0.00 0.02 0.00 0.00 61.00 62.96 2x1x s PRO 196 Cb 0.00 -3.90 -0.04 0.00 0.02 0.00 0.00 34.50 30.58 2x1x s PRO 196 CO 0.00 -0.79 0.06 -1.59 -0.33 0.00 0.00 177.00 174.35 2x1x s LYS 197 N 3.81 3.93 -0.38 5.54 -2.85 -1.00 -4.86 119.74 123.93 2x1x s LYS 197 Ca 0.67 -0.36 -0.28 0.00 -1.00 0.00 0.00 55.97 54.99 2x1x s LYS 197 Cb -0.29 -3.21 -0.01 0.00 -2.06 0.00 0.00 37.83 32.25 2x1x s LYS 197 CO 0.25 0.23 1.74 -1.25 0.10 0.00 0.00 175.35 176.42 2x1x s PRO 198 N 0.48 3.28 0.13 1.78 0.04 -1.26 -1.35 135.00 138.09 2x1x s PRO 198 Ca 0.03 1.23 0.08 0.00 0.04 0.00 0.00 61.00 62.37 2x1x s PRO 198 Cb -0.13 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.18 2x1x s PRO 198 CO 0.01 -1.93 -0.09 0.14 0.04 0.00 0.00 177.00 175.16 2x1x s VAL 199 N 6.95 3.33 -0.02 -0.36 -7.23 0.05 -4.96 120.40 118.16 2x1x s VAL 199 Ca 0.75 -1.39 0.02 0.00 -1.81 0.00 0.00 61.98 59.55 2x1x s VAL 199 Cb -0.20 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 2x1x s VAL 199 CO 0.32 0.04 -0.05 0.42 -0.31 0.00 0.00 175.10 175.52 2x1x s THR 200 N -1.37 3.84 0.00 5.32 -4.23 -1.26 -0.41 115.64 117.53 2x1x s THR 200 Ca 0.23 -0.63 0.03 0.00 -1.18 0.00 0.00 61.69 60.14 2x1x s THR 200 Cb -0.10 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 71.07 2x1x s THR 200 CO 0.14 0.45 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.93 2x1x s ILE 201 N -0.97 0.84 -0.45 2.99 1.01 -0.28 -4.98 121.20 119.36 2x1x s ILE 201 Ca 0.16 -0.56 -0.16 0.00 0.00 0.00 0.00 60.65 60.10 2x1x s ILE 201 Cb -0.11 -0.73 0.05 0.00 0.01 0.00 0.00 42.46 41.68 2x1x s ILE 201 CO 0.07 0.17 0.38 -0.55 0.00 0.00 0.00 174.94 175.00 2x1x s SER 202 N -0.44 6.14 -0.13 3.58 0.15 -1.26 -1.20 113.70 120.54 2x1x s SER 202 Ca 0.03 -1.09 -0.06 0.00 0.70 0.00 0.00 55.95 55.53 2x1x s SER 202 Cb -0.05 -2.19 -0.04 0.00 -1.71 0.00 0.00 66.02 62.04 2x1x s SER 202 CO -0.00 -0.59 0.10 -0.36 1.20 0.00 0.00 173.24 173.59 2x1x s PHE 203 N 1.77 3.44 0.22 3.44 0.08 0.33 -4.79 117.98 122.46 2x1x s PHE 203 Ca 0.06 0.37 -0.30 0.00 0.12 0.00 0.00 56.93 57.18 2x1x s PHE 203 Cb -0.21 -1.96 -0.09 0.00 -0.57 0.00 0.00 43.02 40.19 2x1x s PHE 203 CO 0.09 0.54 1.31 0.00 -0.10 0.00 0.00 175.22 177.06 2x1x s ALA 204 N -0.61 3.52 -0.18 5.36 0.00 -1.26 0.28 121.76 128.88 2x1x s ALA 204 Ca 0.12 1.13 -0.00 0.00 0.00 0.00 0.00 51.96 53.21 2x1x s ALA 204 Cb -0.12 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.57 2x1x s ALA 204 CO 0.02 -0.54 -0.07 1.21 0.00 0.00 0.00 175.76 176.38 2x1x s ASN 205 N 0.20 3.04 0.14 0.00 3.04 0.31 -4.70 114.94 116.97 2x1x s ASN 205 Ca 0.55 -0.75 -0.30 0.00 0.04 0.00 0.00 52.86 52.40 2x1x s ASN 205 Cb -0.37 -1.01 -0.07 0.00 -1.54 0.00 0.00 41.25 38.26 2x1x s ASN 205 CO 0.40 -0.18 1.02 -1.00 -3.04 0.00 0.00 177.10 174.31 2x1x s HIS 206 N 1.56 3.72 -0.16 0.43 3.76 -0.18 0.48 115.29 124.90 2x1x s HIS 206 Ca -0.00 1.71 0.04 0.00 -0.15 0.00 0.00 55.06 56.66 2x1x s HIS 206 Cb -0.16 -3.15 -0.04 0.00 1.11 0.00 0.00 32.58 30.34 2x1x s HIS 206 CO -0.08 -0.14 0.15 0.25 -0.85 0.00 0.00 174.74 174.06 2x1x n THR 207 N 2.60 0.00 -3.65 1.30 -2.24 -0.56 -4.74 114.28 106.99 2x1x n THR 207 Ca 0.02 -0.39 -0.15 0.00 -2.27 0.00 0.00 64.05 61.27 2x1x n THR 207 Cb 0.48 0.95 -0.08 0.00 -2.10 0.00 0.00 70.33 69.58 2x1x n THR 207 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x1x s SER 208 N -1.44 -0.56 0.13 3.42 1.04 -1.22 -4.95 113.70 110.12 2x1x s SER 208 Ca 0.01 0.92 0.05 0.00 0.48 0.00 0.00 55.95 57.42 2x1x s SER 208 Cb 0.03 0.92 -0.04 0.00 0.10 0.00 0.00 66.02 67.03 2x1x s SER 208 CO 0.15 -0.33 -0.12 0.00 0.98 0.00 0.00 173.24 173.92 2x1x s ARG 210 N -3.14 0.68 -0.82 0.00 3.52 0.04 -4.86 118.95 114.36 2x1x s ARG 210 Ca 0.12 0.81 -0.25 0.00 -0.13 0.00 0.00 55.73 56.28 2x1x s ARG 210 Cb -0.02 0.33 0.02 0.00 -1.56 0.00 0.00 34.95 33.73 2x1x s ARG 210 CO 0.02 -0.08 1.49 0.00 -0.81 0.00 0.00 175.30 175.92 2x1x s MET 212 N 5.84 3.08 0.52 0.00 1.00 -0.90 -4.75 119.30 124.10 2x1x s MET 212 Ca 0.47 -0.64 -0.22 0.00 0.00 0.00 0.00 55.69 55.29 2x1x s MET 212 Cb -0.06 -2.82 -0.06 0.00 0.00 0.00 0.00 34.83 31.89 2x1x s MET 212 CO 0.07 0.56 1.34 -1.13 0.00 0.00 0.00 175.02 175.86 2x1x n SER 213 N 0.21 2.67 -0.05 3.03 3.41 -1.26 -1.70 113.62 119.93 2x1x n SER 213 Ca -0.07 1.00 -0.13 0.00 -0.26 0.00 0.00 58.87 59.40 2x1x n SER 213 Cb 0.52 -1.56 -0.08 0.00 -0.26 0.00 0.00 64.21 62.83 2x1x n SER 213 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2x1x h LYS 214 N 1.57 0.32 0.00 4.33 1.57 -1.59 -3.46 116.57 119.31 2x1x h LYS 214 Ca -0.50 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.09 2x1x h LYS 214 Cb 1.30 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2x1x h LYS 214 CO 0.58 0.76 0.00 1.28 -0.57 0.00 0.00 179.45 181.50